2WP4
crystal structure of Rv3119 from Mycobacterium tuberculosis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PAL/PLS BEAMLINE 4A |
| Synchrotron site | PAL/PLS |
| Beamline | 4A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-05-31 |
| Detector | ADSC CCD |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 62.464, 64.353, 91.928 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.820 - 2.490 |
| R-factor | 0.20236 |
| Rwork | 0.200 |
| R-free | 0.24694 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2q5w |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.106 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.540 |
| High resolution limit [Å] | 2.500 | 2.500 |
| Rmerge | 0.060 | 0.380 |
| Number of reflections | 13457 | |
| <I/σ(I)> | 37.2 | 3.4 |
| Completeness [%] | 99.9 | 99.7 |
| Redundancy | 7.8 | 6.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 30% MPD, 0.1 M ACETATE PH 4.6, 0.02 M CALCIUM CHLORIDE |
